SCHEMBL20726556

SCHEMBL20726556

CC1C=CC(CNC(=O)c2csc(Nc3ccccc3)n2)=CC1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 3/20 0.48
▸ LMNA P02545 3/20 0.48
▸ MAPK1 P28482 1/20 0.48
▸ AMY1A P0DUB6 3/20 0.45
▸ CHEK1 O14757 1/20 0.44
▸ MEN1 O00255 2/20 0.44
▸ KMT2A Q03164 2/20 0.44
▸ GAA P10253 3/20 0.42
▸ RECQL P46063 1/20 0.42
▸ NPSR1 Q6W5P4 1/20 0.42
▸ TDP1 Q9NUW8 1/20 0.42
▸ CLK1 P49759 2/20 0.41
▸ CLK4 Q9HAZ1 2/20 0.41
▸ DYRK3 O43781 1/20 0.41
▸ CLK2 P49760 1/20 0.41
▸ DYRK1A Q13627 1/20 0.41
▸ DYRK2 Q92630 1/20 0.41
▸ DYRK1B Q9Y463 1/20 0.41
▸ TRPC3 Q13507 4/20 0.41
▸ TRPC6 Q9Y210 4/20 0.41

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL24180555 0.82 LMNA (0.36) MAPTLMNAMAPK1GAAALDH1A1
SCHEMBL2373449 0.77 AMY1A (0.57) MAPTLMNAMAPK1AMY1ACHEK1
SCHEMBL13116110 0.75 AMY1A (0.58) MAPTLMNAMAPK1AMY1ACHEK1
SCHEMBL29332847 0.74 BRD4 (0.40) LMNAALDH1A1HPGD
SCHEMBL12560881 0.71 AMY1A (0.62) MAPTAMY1ACHEK1MEN1KMT2A
SCHEMBL2373924 0.71 NAMPT (0.57) MAPTLMNAMAPK1AMY1AMEN1
SCHEMBL24776615 0.71 MAPT (0.37) MAPTLMNAMAPK1GAAALDH1A1
SCHEMBL24180547 0.70 MAPT (0.49) MAPTLMNAMAPK1AMY1ACHEK1
SCHEMBL13342146 0.69 AMY1A (0.60) MAPTAMY1ACHEK1MEN1KMT2A
SCHEMBL14214492 0.69 AMY1A (0.61) MAPTLMNAMAPK1AMY1AMEN1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3936508-A1 A COMPOSITION COMPRISING STEM CELL CULTURES The Scripps Research Institute (US) 2022-01-12 — — EP disclosed
EP-3623374-A1 STEM CELL CULTURES The Scripps Research Institute (US) 2020-03-18 — — EP disclosed
EP-3441394-A1 STEM CELL CULTURES The Scripps Research Institute (US) 2019-02-13 — — EP disclosed
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